proton {} end :== observed [] [] --{Set the observed proton shift or shifts for the protons in the selection(s) to the real value(s).} rcoil --{Set the random coil proton shift for all the protons in the selection to the real value(s).} anisotropy co|cn [iscooh] sc|bb --{Select CA CO O atoms (one in each selection). Say if its a CO or CN bond, if its part of a carboxyl group (which are averaged together), and whether it is a backbone or sidechain CO.} amides --{Select all the backbone amide protons.} carbons --{Select all the backbone carbonyl carbon atoms.} nitrogens --{Select all the backbone nitrogen atoms.} oxygens --{Select all the backbone oxygen atoms.} ringatoms phe|tyr|his|trp5|trp6|ade6|ade5|gua6|gua5|thy|cyt|ura [] --{Say how many atoms are in the ring, and select each one in turn. The last selection is only for six-member rings.} alphasandamides --{Select both alpha and amide protons.} class= --{Starts a new class which applies to all assignment and force entries until another class entry is issued.} error --{The error to be used by the current class in square well calculations. Default=0.3} forceconstant [] --{Force constant and Constantine force constant for all assignments in the current class. Default=0.1} potential square|harmonic|multiple --{Use shift errors or not.} print threshold all|class= rmsd|normsd --{Print proton shift violations greater than the specified value (in ppm) for all classes or for the specified class and potentially print the results to the rmsd array.} reset --{Erase the proton shift assignment table.}